Chem
J-GLOBAL ID:200907051225207180   Nikkaji number:J665.185B

[3-(Acetyloxymethyl)-7-(dichloromethylene)cepham-3-ene-4-carboxylic acid benzhydryl]1,1-dioxide

[3-(アセチルオキシメチル)-7-(ジクロロメチレン)セファム-3-エン-4-カルボン酸ベンズヒドリル]1,1-ジオキシド
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C24H19Cl2NO5[O-]2[S+2]
Molecular formula furigana: C24-H19-CL2-N-O7-S
Molecular weight: 536.380
InChI: InChI=1S/C24H19Cl2NO7S/c1-14(28)33-12-17-13-35(31,32)23-18(21(25)26)22(29)27(23)19(17)24(30)34-20(15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-11,20,23H,12-13H2,1H3/t23-/m1/s1
InChI key: CLEBTYABRZNWRJ-HSZRJFAPSA-N
SMILES: CC(=O)OCC1=C(N2[C@@H](C(=C(Cl)Cl)C2=O)[S+2]([O-])([O-])C1)C(=O)OC(c1ccccc1)c1ccccc1
Systematic name  (3):
  • [3-(アセチルオキシメチル)-7-(ジクロロメチレン)セファム-3-エン-4-カルボン酸ベンズヒドリル]1,1-ジオキシド
  • (6R)-3-[(アセチルオキシ)メチル]-7-(ジクロロメチリデン)-2-[(ジフェニルメトキシ)カルボニル]-8-オキソ-5-チア-1-アザビシクロ[4.2.0]オクタ-2-エン-5,5-ジイウム-5,5-ビス(オラート)
  • (6R)-3-[(acetyloxy)methyl]-7-(dichloromethylidene)-2-[(diphenylmethoxy)carbonyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-5,5-diium-5,5-bis(olate)
Other name (1):
  • [3-(Acetyloxymethyl)-7-(dichloromethylene)cepham-3-ene-4-carboxylic acid benzhydryl]1,1-dioxide
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